In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 23 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.70 | 7.19 | -22.46 | 1 | 7 | 0 | 90 | 349.441 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 5.48 | -59.57 | 0 | 7 | -1 | 96 | 348.433 | 4 | ↓ |